SCHEMBL571633

SCHEMBL571633

C=CCC1CCC(=O)CC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.37
NOS1 P29475 2/20 0.37
NOS2 P35228 2/20 0.37
PRSS1 P07477 2/20 0.35
CTRC Q99895 2/20 0.35
F2 P00734 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
FAAH O00519 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9354085 0.92 NOS3 (0.33) NOS3NOS1NOS2PRSS1CTRC
SCHEMBL9354075 0.92 NOS3 (0.33) NOS3NOS1NOS2PRSS1CTRC
Ethylene SCHEMBL10406744 0.90 NOS3 (0.36) NOS3NOS1NOS2PRSS1CTRC
SCHEMBL9013874 0.88 NOS3 (0.32) NOS3NOS1NOS2PRSS1CTRC
SCHEMBL9013881 0.88 NOS3 (0.32) NOS3NOS1NOS2PRSS1CTRC
SCHEMBL8858074 0.87 NOS3 (0.33) NOS3NOS1NOS2PRSS1CTRC
SCHEMBL8858069 0.87 NOS3 (0.33) NOS3NOS1NOS2PRSS1CTRC
SCHEMBL17815526 0.86
SCHEMBL17815530 0.86
SCHEMBL5069027 0.86

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 193 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116948656-B Application of ionic liquid in preparation of fluoroalkyl cyclohexyl biphenyl liquid crystal compounds 河北美星化工有限公司 2024-07-09 CN claimed
CN-116948656-A Application of ionic liquid in preparation of fluoroalkyl cyclohexyl biphenyl liquid crystal compounds 河北美星化工有限公司 2023-10-27 CN claimed
CN-110628069-A Plastic part surface treating agent for repairing injection molding surface defects and preparation method thereof 常州市华虹化工有限公司 2019-12-31 CN claimed
CN-104529955-A Preparation technique of alkenyl succinic anhydride SUZHOU TIANMA SPECIALTY CHEMICALS CO LTD 2015-04-22 CN claimed
CN-104496948-A Preparation method of alkenyl succinic anhydride SUZHOU TIANMA SPECIALTY CHEMICALS CO LTD 2015-04-08 CN claimed
CN-101508639-A Method of preparing 4-alkyl fatty acid SHANGHAI INST TECHNOLOGY (CN) 2009-08-19 CN claimed
CN-101323563-A Preparation of 4-alkyl cyclohexyl acetaldehyde SHANGHAI KANGPENG CHEMICAL CO (CN) 2008-12-17 CN claimed
CN-101113336-A Dimer liquid crystals compound with halogens on side UNIV YANBIAN (CN) 2008-01-30 CN claimed
US-6858758-B2 Method for producing bisphenols BAYER AKTIENGESELLSCHAFT (DE) 2005-02-22 US claimed
EP-0002136-B1 SUBSTITUTED BENZONITRILES, THEIR PREPARATION, LIQUID CRYSTAL COMPOSITIONS CONTAINING THEM AND DISPLAY DEVICES EMPLOYING SUCH COMPOSITIONS Chisso Corporation (JP) 1981-10-21 EP claimed
US-4211666-A ALKYLCYCLOHEXENES WITH A CYANOPHENYL OR CYANOBIPHENYL GROUP CHISSO CORPORATION (JP) 1980-07-08 US claimed
EP-0002136-A1 Substituted benzonitriles, their preparation, liquid crystal compositions containing them and display devices employing such compositions Chisso Corporation (JP) 1979-05-30 EP claimed
JP-63250332-A None JP disclosed
JP-11349548-A None JP disclosed
JP-61207347-A None JP disclosed
JP-11302207-A None JP disclosed
EP-0002136-A1 Substituted benzonitriles, their preparation, liquid crystal compositions containing them and display devices employing such compositions Chisso Corporation (JP) 1979-05-30 EP disclosed
EP-0002136-A1 Substituted benzonitriles, their preparation, liquid crystal compositions containing them and display devices employing such compositions Chisso Corporation (JP) 1979-05-30 EP disclosed
US-4154697-A Liquid crystalline hexahydroterphenyl derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1979-05-15 US disclosed
US-4124374-A Alkyl-substituted cycloalkanapyrazole herbicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-11-07 US disclosed